ID: 109726
SMILES:C12C(CCC(C)=C1)C(C)(Oc1c(O)c(O)cc(CCCCC)c1)CC2OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.243
InChIKey:WLMVXHVAVRFGQI-UHFFFAOYSA-N
ID: 109727
SMILES:O(C)c1cc(Cc2c3c4c(cc2O)C=CC(C)(C)O4)cc(O)c1C1C=C(C)CCC1C(C)(C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: Not available
InChIKey:CSTHFELTLSCZTO-UHFFFAOYSA-N
ID: 109728
SMILES:C(=C(C)C)CC1=C(C(c2c(O)c(C=O)c(O)c(C)c2)C#N)C(CCCC(C)C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 423.597
CB1 binding score: -14.052
InChIKey:CONSUCKBRKZNAV-UHFFFAOYSA-N
ID: 109729
SMILES:CC(C1CCC2(C)Oc3cc(C)c(CCCCC)cc3CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -14.127
InChIKey:MKAWMJDGZUYVPS-UHFFFAOYSA-N
ID: 109730
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 109731
SMILES:C12CC3C(C)(C)Oc4ccc(O)c(c4)CC34C3(O)OC(C(C)=C1)CC24O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -13.99
InChIKey:UYXICJXCJPSTFJ-UHFFFAOYSA-N
ID: 109732
SMILES:C(=C(C(O)=O)C)CCC(=CCc1c(O)cc(CCCCC)cc1OC(=O)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.196
InChIKey:OODDJDYLHFZIPI-UHFFFAOYSA-N
ID: 109733
SMILES:Cc1c(CCC(C)CCc2c(O)c(C)cc(OC)c2)cc2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -15.889
InChIKey:WYHZKWQGHHFESA-UHFFFAOYSA-N
ID: 109734
SMILES:C1Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.815
InChIKey:MPAWLJONWQGACJ-UHFFFAOYSA-N
ID: 109735
SMILES:C(Oc1cc(CCCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2)OCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.76
InChIKey:KCXMIZPVONDQDB-UHFFFAOYSA-N
ID: 109736
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 109737
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(=C(C)C=O)CCC(C2(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.46
InChIKey:MKSFVCVXVAJTOC-UHFFFAOYSA-N
ID: 109738
SMILES:CC(C)(C1CC(O)C2(C)C(C1)O2)CCC(C)=CCc1cc(OC)cc(C)c1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.346
InChIKey:YQKMEZCEKAGVQF-UHFFFAOYSA-N
ID: 109739
SMILES:C(CCc1cc(OC)c(C2C(C(=C)C)CC(O)C3(C)OC3C2)cc1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -10.38
InChIKey:HTDWUBMDNMALPL-UHFFFAOYSA-N
ID: 109740
SMILES:c1c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 109741
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 109742
SMILES:C12C(C=C(C)C(O)c3c(O)cc(CCCCC)cc3O1)C(C(C)CO)CCC2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -12.977
InChIKey:SJFPCHRLKNGQOS-UHFFFAOYSA-N
ID: 109743
SMILES:C(=CCCC(C)=CC1CCC(C)=CC1c1cc(CCCCC)cc(O)c1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.081
InChIKey:IMEBUTPIBUNSJJ-UHFFFAOYSA-N
ID: 109744
SMILES:c1c(O)c(CC=C(CCC=C(C)CCC=C(C)C)C)c(OC)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.631
CB1 binding score: -18.943
InChIKey:QOVOSRUONCHPIN-UHFFFAOYSA-N
ID: 109745
SMILES:C(C1C(C)(O)C(CCCO)C(C)(C)CC1)c1cc(C(=O)O)c(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.59
CB1 binding score: -13.979
InChIKey:SEXVAAYOPVDIQM-UHFFFAOYSA-N
ID: 109746
SMILES:C1C2(C)Oc3cc(CCCCC)cc(O)c3C2C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N